Home Carbonyls 2-{[(tert-butoxy)carbonyl]amino}-3-ethoxypropanoic acid

2-{[(tert-butoxy)carbonyl]amino}-3-ethoxypropanoic acid

CAS No.:
856417-66-8
Catalog Number:
AG01EKDX
Molecular Formula:
C10H19NO5
Molecular Weight:
233.2616
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Product Description
Catalog Number:
AG01EKDX
Chemical Name:
2-{[(tert-butoxy)carbonyl]amino}-3-ethoxypropanoic acid
CAS Number:
856417-66-8
Molecular Formula:
C10H19NO5
Molecular Weight:
233.2616
MDL Number:
MFCD02682572
IUPAC Name:
3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C10H19NO5/c1-5-15-6-7(8(12)13)11-9(14)16-10(2,3)4/h7H,5-6H2,1-4H3,(H,11,14)(H,12,13)
InChI Key:
KNBDVSSESAKBJM-UHFFFAOYSA-N
SMILES:
CCOCC(C(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.126g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
233.264g/mol
Monoisotopic Mass:
233.126g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties